methyl 2-(3-oxidanylidene-7-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)ethanoate

Systemtic Name: methyl 2-(3-oxidanylidene-7-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)ethanoate Openeye Name: methyl 2-(3-oxo-7-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)acetate CAS Name: 2-[3-oxo-7-(1-pyrrolidinylsulfonyl)-1,4-benzothiazin-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-(3-oxo-7-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-7-pyrrolidinosulfonyl-1,4-benzothiazin-4-yl)acetic acid methyl ester Formula: C15H18N2O5S2 MolecularWeight: 370.44382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)CSC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)CN1C(=O)CSC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C15H18N2O5S2/c1-22-15(19)9-17-12-5-4-11(8-13(12)23-10-14(17)18)24(20,21)16-6-2-3-7-16/h4-5,8H,2-3,6-7,9-10H2,1H3